Bis-7-O-8.8-O-8-zinniol (CHEBI:211789)

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CHEBI:211789 - Bis-7-O-8.8-O-8-zinniol

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ChEBI ID	CHEBI:211789
ChEBI Name	Bis-7-O-8.8-O-8-zinniol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H40O6
Net Charge	0
Average Mass	496.644
Monoisotopic Mass	496.28249
SMILES	COc1c(C)c(OCC=C(C)C)cc2c1COCc1c(cc(OCC=C(C)C)c(C)c1OC)COC2
InChI	InChI=1S/C30H40O6/c1-19(2)9-11-35-27-13-23-15-33-16-24-14-28(36-12-10-20(3)4)22(6)30(32-8)26(24)18-34-17-25(23)29(31-7)21(27)5/h9-10,13-14H,11-12,15-18H2,1-8H3
InChIKey	WQGCUWCCMKFHOM-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Alternaria tagetica (ncbitaxon:160391)	-	PubMed (10978208)

ChEBI Ontology

Outgoing Relation(s)
	Bis-7-O-8.8-O-8-zinniol (CHEBI:211789) is a methoxybenzenes (CHEBI:51683)

IUPAC Name
6,18-dimethoxy-7,17-dimethyl-8,16-bis(3-methylbut-2-enoxy)-3,12-dioxatricyclo[12.4.0.05,10]octadeca-1(18),5,7,9,14,16-hexaene

Manual Xrefs	Databases
9014301	ChemSpider